methyl 2-[6-azanyl-3-oxidanylidene-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-[6-azanyl-3-oxidanylidene-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-[6-amino-3-oxo-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]acetate CAS Name: 2-[6-amino-3-oxo-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-amino-3-oxo-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]acetate Traditional Name: 2-[6-amino-3-keto-7-(3-phenylpropylamino)-4H-quinoxalin-2-yl]acetic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NC2=CC(=C(C=C2NC1=O)N)NCCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1=NC2=CC(=C(C=C2NC1=O)N)NCCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-27-19(25)12-18-20(26)24-16-10-14(21)15(11-17(16)23-18)22-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-11,22H,5,8-9,12,21H2,1H3,(H,24,26)